1-naphthalen-1-yl-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)urea

Systemtic Name: 1-naphthalen-1-yl-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)urea Openeye Name: 1-(1-naphthyl)-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)urea CAS Name: 1-(1-naphthalenyl)-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)urea IUPAC Name: 1-naphthalen-1-yl-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)urea Traditional Name: 1-(1-naphthyl)-3-phenyl-1-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)urea Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCSC(=NC1)N(C2=CC=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCSC(=NC1)N(C2=CC=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H21N3OS/c26-21(24-18-11-2-1-3-12-18)25(22-23-15-6-7-16-27-22)20-14-8-10-17-9-4-5-13-19(17)20/h1-5,8-14H,6-7,15-16H2,(H,24,26)