3-acetamido-N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(4-methoxyphenyl)propanamide

Systemtic Name: 3-acetamido-N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(4-methoxyphenyl)propanamide Openeye Name: 3-acetamido-N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-3-(4-methoxyphenyl)propanamide CAS Name: 3-acetamido-N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-3-(4-methoxyphenyl)propanamide IUPAC Name: 3-acetamido-N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(4-methoxyphenyl)propanamide Traditional Name: 3-acetamido-N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-3-(4-methoxyphenyl)propionamide Formula: C18H22N4O4S2 MolecularWeight: 422.52168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CC(C2=CC=C(C=C2)OC)NC(=O)C)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CC(C2=CC=C(C=C2)OC)NC(=O)C)SCC(=O)N

InChI

InChI=1S/C18H22N4O4S2/c1-10-17(27-9-15(19)24)28-18(20-10)22-16(25)8-14(21-11(2)23)12-4-6-13(26-3)7-5-12/h4-7,14H,8-9H2,1-3H3,(H2,19,24)(H,21,23)(H,20,22,25)