4-[[5-(2-acetamidophenyl)carbonyl-4-azanyl-1,3-thiazol-2-yl]amino]-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide

Systemtic Name: 4-[[5-(2-acetamidophenyl)carbonyl-4-azanyl-1,3-thiazol-2-yl]amino]-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide Openeye Name: 4-[[5-(2-acetamidobenzoyl)-4-amino-thiazol-2-yl]amino]-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide CAS Name: 4-[[5-[(2-acetamidophenyl)-oxomethyl]-4-amino-2-thiazolyl]amino]-N-[(1-methyl-2-pyrrolidinyl)methyl]benzamide IUPAC Name: 4-[[5-(2-acetamidobenzoyl)-4-amino-1,3-thiazol-2-yl]amino]-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide Traditional Name: 4-[[5-(2-acetamidobenzoyl)-4-amino-thiazol-2-yl]amino]-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide Formula: C25H28N6O3S MolecularWeight: 492.59322

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1C(=O)C2=C(N=C(S2)NC3=CC=C(C=C3)C(=O)NCC4CCCN4C)N

Isomeric SMILES

CC(=O)NC1=CC=CC=C1C(=O)C2=C(N=C(S2)NC3=CC=C(C=C3)C(=O)NCC4CCCN4C)N

InChI

InChI=1S/C25H28N6O3S/c1-15(32)28-20-8-4-3-7-19(20)21(33)22-23(26)30-25(35-22)29-17-11-9-16(10-12-17)24(34)27-14-18-6-5-13-31(18)2/h3-4,7-12,18H,5-6,13-14,26H2,1-2H3,(H,27,34)(H,28,32)(H,29,30)