1-[(4-methoxyphenyl)methyl]-3-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]thiourea

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]thiourea Openeye Name: 1-[(4-methoxyphenyl)methyl]-3-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]thiourea CAS Name: 1-[(4-methoxyphenyl)methyl]-3-[[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]amino]thiourea IUPAC Name: 1-[(4-methoxyphenyl)methyl]-3-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]thiourea Traditional Name: 1-[4-(2-keto-1,3-benzoxazol-3-yl)butanoylamino]-3-p-anisyl-thiourea Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NNC(=O)CCCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NNC(=O)CCCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C20H22N4O4S/c1-27-15-10-8-14(9-11-15)13-21-19(29)23-22-18(25)7-4-12-24-16-5-2-3-6-17(16)28-20(24)26/h2-3,5-6,8-11H,4,7,12-13H2,1H3,(H,22,25)(H2,21,23,29)