3-azanyl-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide hydrochloride

Systemtic Name: 3-azanyl-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide hydrochloride Openeye Name: 3-amino-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-(2-thienylmethyl)pyrazine-2-carboxamide hydrochloride CAS Name: 3-amino-6-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-N-(thiophen-2-ylmethyl)-2-pyrazinecarboxamide hydrochloride IUPAC Name: 3-amino-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide hydrochloride Traditional Name: 3-amino-6-[4-(4-methylpiperazino)sulfonylphenyl]-N-(2-thenyl)pyrazinamide hydrochloride Formula: C21H25ClN6O3S2 MolecularWeight: 509.0446

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NCC4=CC=CS4)N.Cl

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NCC4=CC=CS4)N.Cl

InChI

InChI=1S/C21H24N6O3S2.ClH/c1-26-8-10-27(11-9-26)32(29,30)17-6-4-15(5-7-17)18-14-23-20(22)19(25-18)21(28)24-13-16-3-2-12-31-16;/h2-7,12,14H,8-11,13H2,1H3,(H2,22,23)(H,24,28);1H