N-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-[2-methyl-5-(thiophen-3-ylcarbonylamino)phenyl]pyridine-3-carboxamide

Systemtic Name: N-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-[2-methyl-5-(thiophen-3-ylcarbonylamino)phenyl]pyridine-3-carboxamide Openeye Name: N-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-[2-methyl-5-(thiophene-3-carbonylamino)phenyl]pyridine-3-carboxamide CAS Name: 6-[2-methyl-5-[[oxo(3-thiophenyl)methyl]amino]phenyl]-N-[2-[(4-methyl-1-piperazinyl)methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[(4-methylpiperazin-1-yl)methyl]phenyl]-6-[2-methyl-5-(thiophene-3-carbonylamino)phenyl]pyridine-3-carboxamide Traditional Name: N-[2-[(4-methylpiperazino)methyl]phenyl]-6-[2-methyl-5-(3-thenoylamino)phenyl]nicotinamide Formula: C30H31N5O2S MolecularWeight: 525.66444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CSC=C2)C3=NC=C(C=C3)C(=O)NC4=CC=CC=C4CN5CCN(CC5)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CSC=C2)C3=NC=C(C=C3)C(=O)NC4=CC=CC=C4CN5CCN(CC5)C

InChI

InChI=1S/C30H31N5O2S/c1-21-7-9-25(32-30(37)24-11-16-38-20-24)17-26(21)28-10-8-22(18-31-28)29(36)33-27-6-4-3-5-23(27)19-35-14-12-34(2)13-15-35/h3-11,16-18,20H,12-15,19H2,1-2H3,(H,32,37)(H,33,36)