N-[1-[[3-(cyclopropylcarbonylamino)phenyl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-[[3-(cyclopropylcarbonylamino)phenyl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-[[3-(cyclopropanecarbonylamino)phenyl]methylcarbamoyl]-2-methyl-propyl]thiophene-2-carboxamide CAS Name: N-[1-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methylamino]-3-methyl-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[[3-(cyclopropanecarbonylamino)phenyl]methylamino]-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-[[3-(cyclopropanecarbonylamino)benzyl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC(=CC=C1)NC(=O)C2CC2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)NCC1=CC(=CC=C1)NC(=O)C2CC2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H25N3O3S/c1-13(2)18(24-20(26)17-7-4-10-28-17)21(27)22-12-14-5-3-6-16(11-14)23-19(25)15-8-9-15/h3-7,10-11,13,15,18H,8-9,12H2,1-2H3,(H,22,27)(H,23,25)(H,24,26)