N-[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-4-(oxiran-2-ylcarbonylamino)pyrrole-2-carboxamide hydrochloride

Systemtic Name: N-[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-4-(oxiran-2-ylcarbonylamino)pyrrole-2-carboxamide hydrochloride Openeye Name: N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-4-(oxirane-2-carbonylamino)pyrrole-2-carboxamide hydrochloride CAS Name: N-[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-methyl-3-pyrrolyl]-1-methyl-4-[[2-oxiranyl(oxo)methyl]amino]-2-pyrrolecarboxamide hydrochloride IUPAC Name: N-[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]-1-methyl-4-(oxirane-2-carbonylamino)pyrrole-2-carboxamide hydrochloride Traditional Name: N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-4-(oxirane-2-carbonylamino)pyrrole-2-carboxamide hydrochloride Formula: C18H24ClN7O4 MolecularWeight: 437.88066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCC(=N)N)C)NC(=O)C3CO3.Cl

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCC(=N)N)C)NC(=O)C3CO3.Cl

InChI

InChI=1S/C18H23N7O4.ClH/c1-24-7-10(5-12(24)16(26)21-4-3-15(19)20)22-17(27)13-6-11(8-25(13)2)23-18(28)14-9-29-14;/h5-8,14H,3-4,9H2,1-2H3,(H3,19,20)(H,21,26)(H,22,27)(H,23,28);1H