N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-methyl-ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-methyl-ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-methyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-(1,3-benzothiazol-2-ylmethylthio)-N-methylacetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-methylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(1,3-benzothiazol-2-ylmethylthio)-N-methyl-acetamide Formula: C19H23N5O3S2 MolecularWeight: 433.54762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)CSCC2=NC3=CC=CC=C3S2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)CSCC2=NC3=CC=CC=C3S2)N

InChI

InChI=1S/C19H23N5O3S2/c1-3-4-9-24-17(20)16(18(26)22-19(24)27)23(2)15(25)11-28-10-14-21-12-7-5-6-8-13(12)29-14/h5-8H,3-4,9-11,20H2,1-2H3,(H,22,26,27)