4-[3-azanyl-4-(1,3-benzothiazol-2-yl)-5-[(4-propan-2-ylphenyl)amino]thiophen-2-yl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[3-azanyl-4-(1,3-benzothiazol-2-yl)-5-[(4-propan-2-ylphenyl)amino]thiophen-2-yl]-7-methoxy-chromen-2-one Openeye Name: 4-[3-amino-4-(1,3-benzothiazol-2-yl)-5-(4-isopropylanilino)-2-thienyl]-7-methoxy-chromen-2-one CAS Name: 4-[3-amino-4-(1,3-benzothiazol-2-yl)-5-(4-propan-2-ylanilino)-2-thiophenyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[3-amino-4-(1,3-benzothiazol-2-yl)-5-(4-propan-2-ylanilino)thiophen-2-yl]-7-methoxychromen-2-one Traditional Name: 4-[3-amino-4-(1,3-benzothiazol-2-yl)-5-cumidino-2-thienyl]-7-methoxy-coumarin Formula: C30H25N3O3S2 MolecularWeight: 539.6678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=C(C(=C(S2)C3=CC(=O)OC4=C3C=CC(=C4)OC)N)C5=NC6=CC=CC=C6S5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=C(C(=C(S2)C3=CC(=O)OC4=C3C=CC(=C4)OC)N)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C30H25N3O3S2/c1-16(2)17-8-10-18(11-9-17)32-29-26(30-33-22-6-4-5-7-24(22)37-30)27(31)28(38-29)21-15-25(34)36-23-14-19(35-3)12-13-20(21)23/h4-16,32H,31H2,1-3H3