N-[3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-methyl-amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-methyl-amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-methyl-amino]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-methylamino]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-methylamino]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-methyl-amino]-3-keto-propyl]thiophene-3-carboxamide Formula: C17H23N5O4S MolecularWeight: 393.46062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)CCNC(=O)C2=CSC=C2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)CCNC(=O)C2=CSC=C2)N

InChI

InChI=1S/C17H23N5O4S/c1-3-4-8-22-14(18)13(16(25)20-17(22)26)21(2)12(23)5-7-19-15(24)11-6-9-27-10-11/h6,9-10H,3-5,7-8,18H2,1-2H3,(H,19,24)(H,20,25,26)