S-[(6-methoxy-1,3-benzothiazol-2-yl)] N-butyl-N-[6-[(2-chlorophenyl)carbamoyl]-5-oxidanyl-naphthalen-1-yl]carbamothioate

Systemtic Name: S-[(6-methoxy-1,3-benzothiazol-2-yl)] N-butyl-N-[6-[(2-chlorophenyl)carbamoyl]-5-oxidanyl-naphthalen-1-yl]carbamothioate Openeye Name: S-[(6-methoxy-1,3-benzothiazol-2-yl)] N-butyl-N-[6-[(2-chlorophenyl)carbamoyl]-5-hydroxy-1-naphthyl]carbamothioate CAS Name: N-butyl-N-[6-[(2-chloroanilino)-oxomethyl]-5-hydroxy-1-naphthalenyl]carbamothioic acid S-[(6-methoxy-1,3-benzothiazol-2-yl)] ester IUPAC Name: S-[(6-methoxy-1,3-benzothiazol-2-yl)] N-butyl-N-[6-[(2-chlorophenyl)carbamoyl]-5-hydroxynaphthalen-1-yl]carbamothioate Traditional Name: N-butyl-N-[6-[(2-chlorophenyl)carbamoyl]-5-hydroxy-1-naphthyl]thiocarbamic acid S-[(6-methoxy-1,3-benzothiazol-2-yl)] ester Formula: C30H26ClN3O4S2 MolecularWeight: 592.12814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC2=C1C=CC(=C2O)C(=O)NC3=CC=CC=C3Cl)C(=O)SC4=NC5=C(S4)C=C(C=C5)OC

Isomeric SMILES

CCCCN(C1=CC=CC2=C1C=CC(=C2O)C(=O)NC3=CC=CC=C3Cl)C(=O)SC4=NC5=C(S4)C=C(C=C5)OC

InChI

InChI=1S/C30H26ClN3O4S2/c1-3-4-16-34(30(37)40-29-33-24-15-12-18(38-2)17-26(24)39-29)25-11-7-8-20-19(25)13-14-21(27(20)35)28(36)32-23-10-6-5-9-22(23)31/h5-15,17,35H,3-4,16H2,1-2H3,(H,32,36)