N-[1-oxidanylidene-1-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methylamino]propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-oxidanylidene-1-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methylamino]propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-methyl-2-oxo-2-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methylamino]ethyl]thiophene-2-carboxamide CAS Name: N-[1-oxo-1-[[2-[(4-phenyl-1-piperazinyl)methyl]phenyl]methylamino]propan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-oxo-1-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methylamino]propan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-keto-1-methyl-2-[[2-[(4-phenylpiperazino)methyl]benzyl]amino]ethyl]thiophene-2-carboxamide Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1CN2CCN(CC2)C3=CC=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1CN2CCN(CC2)C3=CC=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C26H30N4O2S/c1-20(28-26(32)24-12-7-17-33-24)25(31)27-18-21-8-5-6-9-22(21)19-29-13-15-30(16-14-29)23-10-3-2-4-11-23/h2-12,17,20H,13-16,18-19H2,1H3,(H,27,31)(H,28,32)