S-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] 4-methoxybenzenecarbothioate

Systemtic Name: S-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] 4-methoxybenzenecarbothioate Openeye Name: S-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] 4-methoxybenzenecarbothioate CAS Name: 4-methoxybenzenecarbothioic acid S-[[[5-(1,3-benzoxazol-2-yl)-2-methylanilino]-oxomethyl]amino] ester IUPAC Name: S-[[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamoylamino] 4-methoxybenzenecarbothioate Traditional Name: 4-methoxythiobenzoic acid S-[[5-(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=C(C=C1)C2=NC3=CC=CC=C3O2)NC(=O)NSC(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)NC(=O)NSC(=O)C4=CC=C(C=C4)OC

InChI

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