2-[(4-cyano-3-cyclopropyl-1,2-oxazol-5-yl)carbamoylamino]-6-oxidanyl-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[(4-cyano-3-cyclopropyl-1,2-oxazol-5-yl)carbamoylamino]-6-oxidanyl-1-benzothiophene-3-carboxamide Openeye Name: 2-[(4-cyano-3-cyclopropyl-isoxazol-5-yl)carbamoylamino]-6-hydroxy-benzothiophene-3-carboxamide CAS Name: 2-[[[(4-cyano-3-cyclopropyl-5-isoxazolyl)amino]-oxomethyl]amino]-6-hydroxy-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(4-cyano-3-cyclopropyl-1,2-oxazol-5-yl)carbamoylamino]-6-hydroxy-1-benzothiophene-3-carboxamide Traditional Name: 2-[(4-cyano-3-cyclopropyl-isoxazol-5-yl)carbamoylamino]-6-hydroxy-benzothiophene-3-carboxamide Formula: C17H13N5O4S MolecularWeight: 383.38122

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NOC(=C2C#N)NC(=O)NC3=C(C4=C(S3)C=C(C=C4)O)C(=O)N

Isomeric SMILES

C1CC1C2=NOC(=C2C#N)NC(=O)NC3=C(C4=C(S3)C=C(C=C4)O)C(=O)N

InChI

InChI=1S/C17H13N5O4S/c18-6-10-13(7-1-2-7)22-26-15(10)20-17(25)21-16-12(14(19)24)9-4-3-8(23)5-11(9)27-16/h3-5,7,23H,1-2H2,(H2,19,24)(H2,20,21,25)