N-[2-[10-[1-(pyridin-2-ylmethyl)piperidin-4-yl]phenothiazin-3-yl]phenyl]ethanamide

Systemtic Name: N-[2-[10-[1-(pyridin-2-ylmethyl)piperidin-4-yl]phenothiazin-3-yl]phenyl]ethanamide Openeye Name: N-[2-[10-[1-(2-pyridylmethyl)-4-piperidyl]phenothiazin-3-yl]phenyl]acetamide CAS Name: N-[2-[10-[1-(2-pyridinylmethyl)-4-piperidinyl]-3-phenothiazinyl]phenyl]acetamide IUPAC Name: N-[2-[10-[1-(pyridin-2-ylmethyl)piperidin-4-yl]phenothiazin-3-yl]phenyl]acetamide Traditional Name: N-[2-[10-[1-(2-pyridylmethyl)-4-piperidyl]phenothiazin-3-yl]phenyl]acetamide Formula: C31H30N4OS MolecularWeight: 506.6611

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1C2=CC3=C(C=C2)N(C4=CC=CC=C4S3)C5CCN(CC5)CC6=CC=CC=N6

Isomeric SMILES

CC(=O)NC1=CC=CC=C1C2=CC3=C(C=C2)N(C4=CC=CC=C4S3)C5CCN(CC5)CC6=CC=CC=N6

InChI

InChI=1S/C31H30N4OS/c1-22(36)33-27-10-3-2-9-26(27)23-13-14-29-31(20-23)37-30-12-5-4-11-28(30)35(29)25-15-18-34(19-16-25)21-24-8-6-7-17-32-24/h2-14,17,20,25H,15-16,18-19,21H2,1H3,(H,33,36)