N-(1-azanyl-1-oxidanylidene-propan-2-yl)-4-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-(phenylmethyl)-N-(1,3-thiazol-4-yl)butanamide

Systemtic Name: N-(1-azanyl-1-oxidanylidene-propan-2-yl)-4-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-(phenylmethyl)-N-(1,3-thiazol-4-yl)butanamide Openeye Name: N-(2-amino-1-methyl-2-oxo-ethyl)-2-benzyl-4-(4-methylpiperazin-1-yl)-4-oxo-N-thiazol-4-yl-butanamide CAS Name: N-(1-amino-1-oxopropan-2-yl)-4-(4-methyl-1-piperazinyl)-4-oxo-2-(phenylmethyl)-N-(4-thiazolyl)butanamide IUPAC Name: N-(1-amino-1-oxopropan-2-yl)-2-benzyl-4-(4-methylpiperazin-1-yl)-4-oxo-N-(1,3-thiazol-4-yl)butanamide Traditional Name: N-(2-amino-2-keto-1-methyl-ethyl)-2-benzyl-4-keto-4-(4-methylpiperazino)-N-thiazol-4-yl-butyramide Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)N(C1=CSC=N1)C(=O)C(CC2=CC=CC=C2)CC(=O)N3CCN(CC3)C

Isomeric SMILES

CC(C(=O)N)N(C1=CSC=N1)C(=O)C(CC2=CC=CC=C2)CC(=O)N3CCN(CC3)C

InChI

InChI=1S/C22H29N5O3S/c1-16(21(23)29)27(19-14-31-15-24-19)22(30)18(12-17-6-4-3-5-7-17)13-20(28)26-10-8-25(2)9-11-26/h3-7,14-16,18H,8-13H2,1-2H3,(H2,23,29)