N-[2-[2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-methyl-benzamide

Systemtic Name: N-[2-[2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-methyl-benzamide Openeye Name: N-[2-[2-(benzhydrylamino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-methyl-benzamide CAS Name: N-[2-[[2-[(diphenylmethyl)amino]-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-4-methylbenzamide IUPAC Name: N-[2-[2-(benzhydrylamino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-methylbenzamide Traditional Name: N-[2-[[2-(benzhydrylamino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]-4-methyl-benzamide Formula: C30H25N3O2S2 MolecularWeight: 523.6684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H25N3O2S2/c1-20-12-14-23(15-13-20)29(35)31-24-16-17-25-26(18-24)37-30(32-25)36-19-27(34)33-28(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-18,28H,19H2,1H3,(H,31,35)(H,33,34)