S-[[3-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] 4-methoxybenzenecarbothioate

Systemtic Name: S-[[3-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] 4-methoxybenzenecarbothioate Openeye Name: S-[[3-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] 4-methoxybenzenecarbothioate CAS Name: 4-methoxybenzenecarbothioic acid S-[[[3-(1,3-benzoxazol-2-yl)-2-methylanilino]-oxomethyl]amino] ester IUPAC Name: S-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamoylamino] 4-methoxybenzenecarbothioate Traditional Name: 4-methoxythiobenzoic acid S-[[3-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] ester Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)NSC(=O)C2=CC=C(C=C2)OC)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)NSC(=O)C2=CC=C(C=C2)OC)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C23H19N3O4S/c1-14-17(21-24-19-7-3-4-9-20(19)30-21)6-5-8-18(14)25-23(28)26-31-22(27)15-10-12-16(29-2)13-11-15/h3-13H,1-2H3,(H2,25,26,28)